| SpectraBase Spectrum ID |
JH4q9PGPL9c |
| Name |
Mitotane |
| CAS Registry Number |
53-19-0 |
| Classification |
Pharmaceutical drug, antineoplastic |
| Copyright |
Copyright © 2024 DigiLab GmbH and Wiley-VCH GmbH. All Rights Reserved. |
| Exact Mass |
317.953661122 u |
| Formula |
C14H10Cl4 |
| InChI |
InChI=1S/C14H10Cl4/c15-10-7-5-9(6-8-10)13(14(17)18)11-3-1-2-4-12(11)16/h1-8,13-14H |
| InChIKey |
JWBOIMRXGHLCPP-UHFFFAOYSA-N |
| Ionization Type |
Electron Ionization (EI) |
| Molecular Weight |
320.046 g/mol |
| Nominal Mass |
318 u |
| Quality |
882 |
| Retention Index |
2230 |
| SMILES |
C(C=1C(=CC=CC1)Cl)(C1=CC=C(C=C1)Cl)C(Cl)Cl |
| SPLASH |
splash10-000i-4980000000-09deee1721c14a33421d |
| Source of Spectrum |
DigiLab GmbH (C) 2024 |
| Synonyms |
Chlodithane
Lysodren
1-chloro-2-(2,2-dichloro-1-(4-chlorophenyl)ethyl)benzene |
| Technique |
GC/MS |
| Wiley ID |
DD2024_010422 |
